Basic information
- CAS
5330-63-2- Standard SMILES
CC(C)(C)OC(=O)Nc1cccc(Cl)c1- InChIKey
NHKRPSNCGCLFHJ-UHFFFAOYSA-N- Molecular formula
- C11H14ClNO2
- Average molar mass
- 227.69 g/mol
- Monoisotopic mass
- 227.0713064
Names & identifiers
- Preferred name
- tert-butyl N-(3-chlorophenyl)carbamate
- IUPAC
- tert-butyl N-(3-chlorophenyl)carbamate
- English name
- ert-butyl N-(3-chlorophenyl)carbamate
- Molecular formula
- C11H14ClNO2
- Molecular weight
- 227.69
Names & synonyms
5330-63-2tert-butyl N-(3-chlorophenyl)carbamateDTXSID30277480RefChem:383801DTXCID70228638tert-Butyl (3-chlorophenyl)carbamateMFCD07127698ert-butyl N-(3-chlorophenyl)carbamateNSC2502TERT-BUTYL 3-CHLOROPHENYLCARBAMATEtert-butyl(3-chlorophenyl)carbamateN-Boc-3-chloroaniline
Show more names
3-chloro-(N-BO-C)benzeneamineCarbamic acid, N-(3-chlorophenyl)-, 1,1-dimethylethyl ester
SCHEMBL3790245SCHEMBL65018901-(Boc-amino)-3-chlorobenzeneSCHEMBL21268291SCHEMBL27894679SCHEMBL28074229NSC-2502AKOS003581107
Database identifiers
- CAS
5330-63-2- PubChem CID
- 220166
- DTXSID
DTXSID30277480- Nikkaji
- J1.673.488H
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 225
Physicochemical properties
- storage temp.
- Store at room temperature
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P403+P233-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P403+P233-P405-P501
Chemistry & industry
Suppliers22 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
安徽合诺生物科技有限公司0555-2761852
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
安徽合诺生物科技有限公司18455579438
菏泽博纳医药科技有限公司15865805009 · [email protected]
上海石鑫医药科技有限公司021-18621020637 18621020637 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
安徽凯泽合联医药科技有限公司18130062233 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
陕西缔都医药化工有限公司+86-29-87569266 +86-17392581500 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
1 records
Compound notes
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